3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide

C12H17N5 — CID 123150480

IUPAC3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide
SMILES[H]/N=C(/C/C(N)=N/c1cc(C2CC2)[nH]n1)C1CC1
InChIInChI=1S/C12H17N5/c13-9(7-1-2-7)5-11(14)15-12-6-10(16-17-12)8-3-4-8/h6-8,13H,1-5H2,(H3,14,15,16,17)/b13-9-
InChIKeyJYTJTJSVBYLRIE-LCYFTJDESA-N
MW231.30 g/mol
LogP2.10
Rot. Bonds5

About 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide

3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide (PubChem CID 123150480) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide.

Molecular Properties

Compound Name3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide
PubChem CID123150480
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide
SMILES[H]/N=C(/C/C(N)=N/c1cc(C2CC2)[nH]n1)C1CC1
InChIInChI=1S/C12H17N5/c13-9(7-1-2-7)5-11(14)15-12-6-10(16-17-12)8-3-4-8/h6-8,13H,1-5H2,(H3,14,15,16,17)/b13-9-
InChIKeyJYTJTJSVBYLRIE-LCYFTJDESA-N
XLogP2.10
TPSA90.91 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-[2-[(dimethylamino)methyl]morpholin-4-yl]-3-iminopropanimidamide
CID 123566647
3-(4-hydroxypiperidin-1-yl)-3-imino-N'-(5-methyl-1H-pyrazol-3-yl)propanimidamide
CID 123836010
3-imino-3-(4-propan-2-ylpiperazin-1-yl)-N'-[5-[(E)-prop-1-enyl]-1H-pyrazol-3-yl]propanimidamide
CID 123974791
N-[(4-aminoanilino)-(methylideneamino)methylidene]-N'-(5-cyclopropyl-1H-pyrazol-3-yl)propanimidamide
CID 123571494
3-imino-3-(5-methylazonan-1-yl)-N'-(5-thiophen-2-yl-1H-pyrazol-3-yl)propanimidamide
CID 123953720
N'-[5-(ethenoxymethyl)-1H-pyrazol-3-yl]-3-imino-3-(4-methylpiperazin-1-yl)propanimidamide
CID 123559514
1-(5-cyclopropyl-1H-pyrazol-3-yl)-1-ethylurea
CID 174442006
1-(5-cyclopropyl-1H-pyrazol-3-yl)piperidin-4-amine
CID 91811818
4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-hydroxy-5-methoxybenzenecarboximidamide
CID 176966040
(Z)-N-[(Z)-1-chloropent-1-enyl]-N'-(5-cyclopentyl-1H-pyrazol-3-yl)but-2-enimidamide
CID 169160053
methyl 2-[(5-cyclopropyl-1H-pyrazole-3-carbonyl)amino]-4-methylpentanoate
CID 47158124
(2-oxo-2-piperidin-1-ylethyl) 5-cyclopropyl-1H-pyrazole-3-carboxylate
CID 55569703

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide?
The IUPAC name of 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide (CID 123150480) is 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide.
What is the SMILES notation for 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide?
The canonical SMILES for 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide is [H]/N=C(/C/C(N)=N/c1cc(C2CC2)[nH]n1)C1CC1.
What is the InChIKey of 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide?
The InChIKey is JYTJTJSVBYLRIE-LCYFTJDESA-N. The full InChI is InChI=1S/C12H17N5/c13-9(7-1-2-7)5-11(14)15-12-6-10(16-17-12)8-3-4-8/h6-8,13H,1-5H2,(H3,14,15,16,17)/b13-9-.
What are the key properties of 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide?
3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide has a molecular weight of 231.30 g/mol, XLogP of 2.10, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N'-(5-cyclopropyl-1H-pyrazol-3-yl)-3-iminopropanimidamide is sourced from PubChem (CID 123150480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).